Vitas-M small molecule compound
2-{[(E)-(1-benzyl-1H-indol-3-yl)methylidene]amino}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Catalog ID
STK264372
SMILES O=C1N(/N=C/c2cn(c3c2cccc3)Cc2ccccc2)C(=O)C2C1C1C=CC2C2C1C2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H23N3O2 MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O2/c31-26-24-19-10-11-20(22-12-21(19)22)25(24)27(32)30(26)28-13-17-15-29(14-16-6-2-1-3-7-16)23-9-5-4-8-18(17)23/h1-11,13,15,19-22,24-25H,12,14H2/b28-13+InChIKey
WWRXLKKVHLBDIO-XODNFHPESA-NSynonyms
2(((E)(1benzyl1Hindol3yl)methylidene)amino)hexahydro46ethenocyclopropa(f)isoindole13(2H3aH)dione
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)N=CC5=CN(C6=CC=CC=C65)CC7=CC=CC=C7
InChI=1SC27H23N3O2c31262419101120(221221(19)22)25(24)27(32)30(26)2813171529(14166213716)23954818(17)23h111131519222425H1214H2b2813+
MFCD06166906
O=C1N(N=Cc2cn(c3c2cccc3)Cc2ccccc2)C(=O)C2C1C1C=CC2C2C1C2
ZINC000252428719
ZINC000252428722
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